CHEBI:118256 - 2-[(2S,3R,6R)-3-[[(3-fluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N,N-dimethylacetamide

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ChEBI Name 2-[(2S,3R,6R)-3-[[(3-fluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N,N-dimethylacetamide
ChEBI ID CHEBI:118256
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H22FN3O4
Net Charge 0
Average Mass 351.373
Monoisotopic Mass 351.15943
InChI InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14+,15+/m0/s1
InChIKey LEYGMNHWBOVNLD-RRFJBIMHSA-N
SMILES CN(C)C(=O)C[C@@H]1C=C[C@H]([C@H](O1)CO)NC(=O)NC2=CC(=CC=C2)F
ChEBI Ontology
Outgoing 2-[(2S,3R,6R)-3-[[(3-fluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N,N-dimethylacetamide (CHEBI:118256) is a ureas (CHEBI:47857)
Manual Xref Database
LSM-29705 LINCS
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